[4-[2-(4-methylphenyl)ethynyl]phenyl] 4-methylbenzoate

Systemtic Name: [4-[2-(4-methylphenyl)ethynyl]phenyl] 4-methylbenzoate Openeye Name: [4-[2-(p-tolyl)ethynyl]phenyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [4-[2-(4-methylphenyl)ethynyl]phenyl] ester IUPAC Name: [4-[2-(4-methylphenyl)ethynyl]phenyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [4-[2-(p-tolyl)ethynyl]phenyl] ester Formula: C23H18O2 MolecularWeight: 326.38782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C#CC2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)C#CC2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C23H18O2/c1-17-3-7-19(8-4-17)9-10-20-11-15-22(16-12-20)25-23(24)21-13-5-18(2)6-14-21/h3-8,11-16H,1-2H3